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N-[(2E,4Z)-4-cyano-5-phenyl-penta-2,4-dienyl]-N-(2-propynyl)benzenesulfonamide
SpectraBase Compound ID 889uumhoEbD
InChI InChI=1S/C21H18N2O2S/c1-2-15-23(26(24,25)21-13-7-4-8-14-21)16-9-12-20(18-22)17-19-10-5-3-6-11-19/h1,3-14,17H,15-16H2/b12-9+,20-17-
InChIKey RHESSUVRXYMQEW-ACDCWFLESA-N
Mol Weight 362.45 g/mol
Molecular Formula C21H18N2O2S
Exact Mass 362.108899 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DTF3e7EpOLe
Name N-[(2E,4Z)-4-Cyano-5-phenyl-penta-2,4-dienyl]-N-(2-propynyl)benzenesulfonamide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 362.108899000 u
Formula C21H18N2O2S
InChI InChI=1S/C21H18N2O2S/c1-2-15-23(26(24,25)21-13-7-4-8-14-21)16-9-12-20(18-22)17-19-10-5-3-6-11-19/h1,3-14,17H,15-16H2/b12-9+,20-17-
InChIKey RHESSUVRXYMQEW-ACDCWFLESA-N
Molecular Weight 362.447 g/mol
SMILES C(N(S(C=1C=CC=CC1)(=O)=O)C\C=C\C(=C\C1=CC=CC=C1)C#N)C#C